N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide

C18H27N3O — CID 174378639

IUPACN-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide
SMILESCCN1CCC(N2CCc3ccc(CNC(C)=O)cc32)CC1
InChIInChI=1S/C18H27N3O/c1-3-20-9-7-17(8-10-20)21-11-6-16-5-4-15(12-18(16)21)13-19-14(2)22/h4-5,12,17H,3,6-11,13H2,1-2H3,(H,19,22)
InChIKeyAMPKIWLJUMDODG-UHFFFAOYSA-N
MW301.43 g/mol
LogP2.17
Rot. Bonds4

About N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide

N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide (PubChem CID 174378639) has the molecular formula C18H27N3O and a molecular weight of 301.43 g/mol. Its IUPAC name is N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide
PubChem CID174378639
Molecular FormulaC18H27N3O
Molecular Weight301.43 g/mol
Exact Mass301.22
IUPAC NameN-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide
SMILESCCN1CCC(N2CCc3ccc(CNC(C)=O)cc32)CC1
InChIInChI=1S/C18H27N3O/c1-3-20-9-7-17(8-10-20)21-11-6-16-5-4-15(12-18(16)21)13-19-14(2)22/h4-5,12,17H,3,6-11,13H2,1-2H3,(H,19,22)
InChIKeyAMPKIWLJUMDODG-UHFFFAOYSA-N
XLogP2.17
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-ethylpiperidin-4-yl)-6-[(1-ethylpiperidin-4-yl)methyl]-2,3-dihydroindole
CID 174441483
N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-2,3-dihydroindol-6-yl]methyl]butanamide
CID 22038292
1-(1-ethylpiperidin-4-yl)-6-(pyridin-4-ylmethyl)-2,3-dihydroindole
CID 174391233
2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-2,3-dihydroindol-6-yl]-N-propylacetamide
CID 22038241
ethane;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole;vanadium
CID 161158486
N-(1-cyclohexyl-2,3-dihydroindol-6-yl)acetamide
CID 142743455
3-(1-cyclobutyl-2,3-dihydroindol-6-yl)propanoic acid
CID 115115116
N-[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]-2-fluorobenzenesulfonamide
CID 174406027
N-[(1-cyclohexyl-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)methyl]acetamide
CID 59396483
anisole;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole
CID 174390999
N-[[4-[(6-chloro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]phenyl]methyl]acetamide
CID 166719135
1-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]-2,3-dihydroindol-6-yl]oxy]ethanol
CID 22038243

Frequently Asked Questions

What is the IUPAC name of N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide?
The IUPAC name of N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide (CID 174378639) is N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide is CCN1CCC(N2CCc3ccc(CNC(C)=O)cc32)CC1.
What is the InChIKey of N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide?
The InChIKey is AMPKIWLJUMDODG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O/c1-3-20-9-7-17(8-10-20)21-11-6-16-5-4-15(12-18(16)21)13-19-14(2)22/h4-5,12,17H,3,6-11,13H2,1-2H3,(H,19,22).
What are the key properties of N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide?
N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide has a molecular weight of 301.43 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(1-ethylpiperidin-4-yl)-2,3-dihydroindol-6-yl]methyl]acetamide is sourced from PubChem (CID 174378639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).